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Updated: Jan 8, 2026

Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
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Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry

Published on: April 8, 2020

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试验确定无干扰水无团 (H2O) 11的结构图案

Tiantong Wang1,2, Yang-Yang Zhang3,4, Shuai Jiang1,2

  • 1State Key Laboratory of Chemical Reaction Dynamics and Dalian Coherent Light Source, Dalian Institute of Chemical Physics, Chinese Academy of Sciences, Dalian, China.

Nature communications
|December 13, 2025
PubMed
概括

研究人员使用尺寸特定的红外光谱学来描述中性水无体的结构 ((H2O) 11). 确定了占主导地位的515结构图案,以堆叠的环形为特征,推进了水网研究.

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Intermolecular Forces

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The probability of having two carbon-13 atoms next to each other is negligible because of the low natural abundance of carbon-13. Consequently, peak splitting due to carbon-carbon spin-spin coupling is not observed in spectra. However, protons up to three sigma bonds away split the carbon signal according to the n+1 rule, resulting in complicated spectra.
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